SCHEMBL540122

SCHEMBL540122

Nc1nc(-c2cccs2)c2[nH]cnc2n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGMT P16455 2/20 0.58
ADORA2A P29274 4/20 0.56
ADORA1 P30542 3/20 0.56
PDPK1 O15530 1/20 0.54
GDA Q9Y2T3 1/20 0.54
DHFR P00374 1/20 0.52
CDK2 P24941 4/20 0.47
DPP4 P27487 1/20 0.47
PIK3CA P42336 1/20 0.45
MTOR P42345 1/20 0.45
PIK3CG P48736 1/20 0.45
MAP3K5 Q99683 1/20 0.44
CDK1 P06493 3/20 0.44
CYP1A2 P05177 3/20 0.44
CYP3A4 P08684 3/20 0.44
CYP2C9 P11712 3/20 0.44
CYP2C19 P33261 3/20 0.44
PIN1 Q13526 2/20 0.44
CYP2D6 P10635 2/20 0.44
CCNB1 P14635 2/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16266000 0.91 MGMT (0.52) MGMTADORA2AADORA1PDPK1GDA
SCHEMBL5998120 0.84 PIK3CA (0.46) MGMTADORA2AADORA1PDPK1GDA
SCHEMBL10380576 0.82 PIK3CA (0.45) MGMTADORA2AADORA1PDPK1GDA
SCHEMBL1029868 0.77 SMN1; SMN2 (0.51) PDPK1CDK2PIK3CAMTORPIK3CG
SCHEMBL4052354 0.77 DHFR (0.52) MGMTADORA2AADORA1DHFRCYP1A2
SCHEMBL540121 0.77 ADORA2A (0.49) MGMTADORA2AADORA1DHFRCYP1A2
SCHEMBL2933190 0.75 ADORA1 (0.69) MGMTADORA2AADORA1PDPK1GDA
SCHEMBL887880 0.75 PDPK1 (0.51) MGMTADORA2AADORA1PDPK1GDA
SCHEMBL27691725 0.72 ADORA2A (1.00) MGMTADORA2AADORA1PDPK1GDA
2,6-Diaminopurine SCHEMBL24053 0.71 PDPK1 (1.00) MGMTADORA2AADORA1PDPK1GDA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 550 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025105897-A1 METHOD FOR DETECTING GENOMIC MUTATION THROUGH NUCLEIC ACID PATTERN-BASED PURIFICATION, AND DISEASE DIAGNOSIS METHOD USING SAME 광주과학기술원 2025-05-22 WO claimed
US-20250154557-A1 COMPOSITION FOR SELECTING NUCLEIC ACIDS OF INTEREST, AND A METHOD FOR SELECTING NUCLEIC ACIDS USING THEREOF GWANGJU INST SCIENCE & TECH (KR) 2025-05-15 US claimed
US-11697812-B2 Methods and compositions for the specific inhibition of transthyretin (TTR) by double-stranded RNA DICERNA PHARMACEUTICALS, INC. (US) 2023-07-11 US claimed
US-11359198-B2 Extended dicer substrate agents and methods for the specific inhibition of gene expression DICERNA PHARMACEUTICALS, INC. (US) 2022-06-14 US claimed
US-20210292757-A1 EXTENDED DICER SUBSTRATE AGENTS AND METHODS FOR THE SPECIFIC INHIBITION OF GENE EXPRESSION NOVO NORDISK A/S (DK) 2021-09-23 US claimed
EP-3865576-A1 LIGAND-MODIFIED DOUBLE-STRANDED NUCLEIC ACIDS Dicerna Pharmaceuticals, Inc. (US) 2021-08-18 EP claimed
US-10870849-B2 Extended dicer substrate agents and methods for the specific inhibition of gene expression DICERNA PHARMACEUTICALS, INC. (US) 2020-12-22 US claimed
US-10837013-B2 Extended dicer substrate agents and methods for the specific inhibition of gene expression DICERNA PHARMACEUTICALS, INC. (US) 2020-11-17 US claimed
US-20200031862-A1 LIGAND-MODIFIED DOUBLE-STRANDED NUCLEIC ACIDS DICERNA PHARMACEUTICALS, INC. 2020-01-30 US claimed
EP-3401407-A1 NUCLEIC ACID PROBE, METHOD FOR DESIGNING NUCLEIC ACID PROBE, AND METHOD FOR DETECTING TARGET SEQUENCE Kabushiki Kaisha Dnaform (JP) 2018-11-14 EP claimed
US-20130041010-A1 COMPOSITIONS AND METHODS FOR THE SPECIFIC INHIBITION OF GENE EXPRESSION BY DSRNA CONTAINING MODIFIED NUCLEOTIDES DICERNA PHARMACEUTICALS, INC. (US) 2013-02-14 US claimed
US-8067162-B2 Replication; hybridization; kits RIKEN (JP) 2011-11-29 US claimed
EP-2341943-A2 COMPOSITIONS AND METHODS FOR THE SPECIFIC INHIBITION OF GENE EXPRESSION BY DSRNA POSSESSING MODIFICATIONS Dicerna Pharmaceuticals, Inc. (US) 2011-07-13 EP claimed
US-20100331389-A1 Compositions and methods for the specific inhibition of gene expression by dsRNA containing modified nucleotides DICERNA PHARMACEUTICALS, INC. 2010-12-30 US claimed
EP-1114827-B1 NOVEL NUCLEIC ACID BASE PAIR JAPAN SCIENCE & TECH AGENCY (JP) 2010-11-17 EP claimed
EP-2223931-A1 Novel nucleic acid base pair Japan Science and Technology Agency (JP) 2010-09-01 EP claimed
WO-2010033225-A2 COMPOSITIONS AND METHODS FOR THE SPECIFIC INHIBITION OF GENE EXPRESSION BY DSRNA POSSESSING MODIFICATIONS DICERNA PHARMACEUTICALS, INC. (US) 2010-03-25 WO claimed
US-20090286247-A1 Novel nucleic acid base pair JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2009-11-19 US claimed
US-20050191689-A1 Novel nucleic acid base pair HIRAO, ICHIRO (JP) 2005-09-01 US claimed
EP-1114827-A1 NOVEL NUCLEIC ACID BASE PAIR Japan Science and Technology Corporation (JP) 2001-07-11 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200031862-A1 LIGAND-MODIFIED DOUBLE-STRANDED NUCLEIC ACIDS ADAR, NCL, SSU72 MGMT 3561/4885ADORA2A 224/4885ADORA1 434/4885
US-20090286247-A1 Novel nucleic acid base pair SNRPE, NSUN2, NSUN3 MGMT 3493/4885ADORA2A 3160/4885ADORA1 3886/4885
US-20050191689-A1 Novel nucleic acid base pair SNRPE, NSUN2, NSUN3 MGMT 3493/4885ADORA2A 3160/4885ADORA1 3886/4885
US-11697812-B2 Methods and compositions for the specific inhibition of transthyretin (TTR) by double-stranded RNA TTR, RNASE1, SARNP MGMT 3538/4885ADORA2A 4297/4885ADORA1 4310/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.